5-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-N-[2-(2-thienyl)ethyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-N-(2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-N-(2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-1,3,4-thiadiazol-2-yl]-[2-(2-thienyl)ethyl]amine Formula: C16H14ClN3O2S3 MolecularWeight: 411.94926

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)CSC3=NN=C(S3)NCCC4=CC=CS4)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)CSC3=NN=C(S3)NCCC4=CC=CS4)Cl

InChI

InChI=1S/C16H14ClN3O2S3/c17-12-6-10(7-13-14(12)22-9-21-13)8-24-16-20-19-15(25-16)18-4-3-11-2-1-5-23-11/h1-2,5-7H,3-4,8-9H2,(H,18,19)